N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2-(9-oxidanylideneacridin-10-yl)ethanamide

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2-(9-oxidanylideneacridin-10-yl)ethanamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-(9-oxoacridin-10-yl)acetamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-2-(9-oxo-10-acridinyl)acetamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-2-(9-oxoacridin-10-yl)acetamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-(9-ketoacridin-10-yl)acetamide Formula: C23H17BrN4O2S MolecularWeight: 493.37568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)NC4=CC=NN4CC5=CC(=CS5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)NC4=CC=NN4CC5=CC(=CS5)Br

InChI

InChI=1S/C23H17BrN4O2S/c24-15-11-16(31-14-15)12-28-21(9-10-25-28)26-22(29)13-27-19-7-3-1-5-17(19)23(30)18-6-2-4-8-20(18)27/h1-11,14H,12-13H2,(H,26,29)